Reaction Details Report a problem with these data
Target
Adenosine deaminase
Ligand
BDBM50011586
Substrate
n/a
Meas. Tech.
ChEBML_30806
Ki
126±n/a nM
Citation
 Cristalli, G; Eleuteri, A; Franchetti, P; Grifantini, M; Vittori, S; Lupidi, G Adenosine deaminase inhibitors: synthesis and structure-activity relationships of imidazole analogues of erythro-9-(2-hydroxy-3-nonyl)adenine. J Med Chem 34:1187-92 (1991) [PubMed]  Article 
Target
Name:
Adenosine deaminase
Synonyms:
ADA | ADA_BOVIN | Adenosine aminohydrolase
Type:
Enzyme
Mol. Mass.:
40910.44
Organism:
Bos taurus (bovine)
Description:
n/a
Residue:
363
Sequence:
MAQTPAFNKPKVELHVHLDGAIKPETILYYGRKRGIALPADTPEELQNIIGMDKPLSLPEFLAKFDYYMPAIAGCREAVKRIAYEFVEMKAKDGVVYVEVRYSPHLLANSKVEPIPWNQAEGDLTPDEVVSLVNQGLQEGERDFGVKVRSILCCMRHQPSWSSEVVELCKKYREQTVVAIDLAGDETIEGSSLFPGHVKAYAEAVKSGVHRTVHAGEVGSANVVKEAVDTLKTERLGHGYHTLEDATLYNRLRQENMHFEVCPWSSYLTGAWKPDTEHPVVRFKNDQVNYSLNTDDPLIFKSTLDTDYQMTKNEMGFTEEEFKRLNINAAKSSFLPEDEKKELLDLLYKAYGMPSPASAEQCL
  
Inhibitor
Name:
BDBM50011586
Synonyms:
5-Chloro-1-[1-(1-hydroxy-ethyl)-heptyl]-1H-imidazole-4-carboxylic acid amide | CHEMBL18078
Type:
Small organic molecule
Emp. Form.:
C13H22ClN3O2
Mol. Mass.:
287.786
SMILES:
CCCCCCC(C(C)O)n1cnc(C(N)=O)c1Cl
Structure:
Search PDB for entries with ligand similarity: